IBS-ZINC02131937 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 1 0 0 0 0 0999 V2000 -0.0220 1.8100 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 -0.4360 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 -1.9590 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3970 -2.3230 0.0220 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8990 -1.8330 -0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5490 -3.8170 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1050 -4.4480 0.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0680 -4.4510 -1.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2150 -5.9030 -1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5870 -6.3660 -2.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7390 -7.8600 -2.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2930 -8.4890 -1.8990 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9990 -1.8790 1.2820 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5280 -2.3650 2.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0080 -2.0210 3.6170 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0300 -1.1370 3.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5460 -0.7660 4.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5840 0.1360 5.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1260 0.6820 3.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6350 0.3320 2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5840 -0.5780 2.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0140 -0.9850 1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4420 -0.5370 0.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1870 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1710 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1610 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 -0.0280 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 -0.0190 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 -2.3660 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -2.3760 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6230 -3.9460 -1.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7140 -6.3930 -0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2740 -6.1620 -1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0890 -5.8760 -3.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 -6.1070 -2.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7140 -3.0740 2.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1330 -1.1850 5.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9820 0.4210 6.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9410 1.3880 3.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0610 0.7610 1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2600 -8.4910 -3.8520 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3810 -9.4500 -3.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 42 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 42 43 1 0 0 0 0 M END